N,1-bis[2-nitro-4-(trifluoromethyl)phenyl]-1-phenyl-N-propyl-methanesulfonamide

Systemtic Name: N,1-bis[2-nitro-4-(trifluoromethyl)phenyl]-1-phenyl-N-propyl-methanesulfonamide Openeye Name: N,1-bis[2-nitro-4-(trifluoromethyl)phenyl]-1-phenyl-N-propyl-methanesulfonamide CAS Name: N,1-bis[2-nitro-4-(trifluoromethyl)phenyl]-1-phenyl-N-propylmethanesulfonamide IUPAC Name: N,1-bis[2-nitro-4-(trifluoromethyl)phenyl]-1-phenyl-N-propylmethanesulfonamide Traditional Name: N,1-bis[2-nitro-4-(trifluoromethyl)phenyl]-1-phenyl-N-propyl-methanesulfonamide Formula: C24H19F6N3O6S MolecularWeight: 591.479579

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C(C2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCN(C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C(C2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C24H19F6N3O6S/c1-2-12-31(19-11-9-17(24(28,29)30)14-21(19)33(36)37)40(38,39)22(15-6-4-3-5-7-15)18-10-8-16(23(25,26)27)13-20(18)32(34)35/h3-11,13-14,22H,2,12H2,1H3